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Theoretical and experimental revision of the water bending excitation in the OH/OD + GeH4 reactions

  • J. Espinosa-GarciaEmail author
  • J. C. Corchado
  • N. I. Butkovskaya
  • D. W. Setser
Letter
  • 37 Downloads

Abstract

The bending force constant associated with formation water that is selected for the potential energy surface describing the OH/OD + GeH4 reaction is shown to be important for the degree of bending excitation of H2O and HOD.

Keywords

Water bending excitation OH/OD + GeH4 reactions Theoretical/experimental discrepancies 

Notes

Acknowledgements

This work was partially supported by Junta de Extremadura and European Regional Development Fund, Spain (Projects Nos. GR18010 and IB16013).

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Copyright information

© Springer-Verlag GmbH Germany, part of Springer Nature 2019

Authors and Affiliations

  1. 1.Departamento de Quimica FisicaUniversidad de ExtremaduraBadajozSpain
  2. 2.N.N. Semenov Federal Research Center for Chemical PhysicsRussian Academy of SciencesMoscowRussian Federation
  3. 3.Department of ChemistryKansas State UniversityManhattanUSA

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